Tan Lab | DSigDB

Gene Set: D4 : Boss - rcra waste number u035

Collection

D4 : Boss

Chemical Name

rcra waste number u035 ( From PubChem : CHLORAMBUCIL )

FDA	NPC	WHO	Indian	Australia	China	Traditional Herbal	Clinical Trail
Approved	Not	Approved	Approved	Not	Not	Not	Not

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
304.212 g/mol	1	3	3.3779	True

Structure

InChI

InChI=1S/C14H19Cl2NO2/c15-8-10-17(11-9-16)13-6-4-12(5-7-13)2-1-3-14(18)19/h4-7H,1-3,8-11H2,(H,18,19)

InChIKey

Links

Gene (12 / 20)

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Source	Type	Unit	Value	Gene	PMID	Other
BOSS	Text Mining			ALB
BOSS	Text Mining			CDT1
BOSS	Text Mining			CEBPZ
BOSS	Text Mining			CREBRF
BOSS	Text Mining			HBB
BOSS	Text Mining			TP53
PubChem	Potency	uM	56.234	BAZ2B	-	GI(Protien) :
PubChem	AC50_uM	uM	0.005	GFER	-	GI(Protien) :
PubChem	None	uM		GFER	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	66.276	NFE2L2	-	GI(Protien) :
PubChem	Potency	uM	8.912	NFKB1	-	GI(Protien) :
PubChem	None	uM		STK33	-	GI(Protien) :
PubChem	Potency	uM	0.461	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.562	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.651	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.891	TDP1	-	GI(Protien) :
PubChem	Potency	uM	14.581	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	56234.100	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	AC50	nM	5.000	GFER	-	Target : CHEMBL1741189
ChEMBL	Potency	nM	8912.500	NFKB1	-	Target : CHEMBL3251

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